SCHEMBL1123230

SCHEMBL1123230

CCOC(=O)CN(Cc1cccc(Oc2ccccc2)c1)C(=O)c1ccc(OCCN(Cc2ccccc2)Cc2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 7/20 0.48
LPAR5 Q9H1C0 6/20 0.48
PPARG P37231 3/20 0.47
PPARA Q07869 3/20 0.47
SLC2A1 P11166 2/20 0.47
PTGES O14684 2/20 0.46
LTA4H P09960 1/20 0.46
TSHR P16473 2/20 0.45
HSD17B10 Q99714 2/20 0.45
NPC1 O15118 1/20 0.43
LMNA P02545 1/20 0.43
ALOX15 P16050 1/20 0.43
MAPK1 P28482 1/20 0.43
ALOX5 P09917 1/20 0.43
MAOB P27338 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1123324 0.94 LPAR1 (0.46) LPAR1LPAR5PPARGPPARASLC2A1
SCHEMBL1123181 0.91 LPAR1 (0.49) LPAR1LPAR5PPARGPPARASLC2A1
SCHEMBL1122837 0.88 PPARG (0.51) LPAR1LPAR5PPARGPPARASLC2A1
SCHEMBL1122799 0.87 L3MBTL1 (0.53) LPAR1LPAR5LTA4HNPC1LMNA
SCHEMBL1122636 0.86 BCHE (0.50) PPARGPPARASLC2A1PTGESNPC1
SCHEMBL1122692 0.85 LPAR1 (0.55) LPAR1LPAR5PPARGPPARASLC2A1
SCHEMBL1123335 0.84 LPAR1 (0.52) LPAR1LPAR5PPARGPPARASLC2A1
SCHEMBL1123277 0.82 PPARG (0.49) LPAR1LPAR5PPARGPPARASLC2A1
SCHEMBL1123229 0.81 SLC2A1 (0.55) SLC2A1PTGESNPC1LMNAALOX5
SCHEMBL1123052 0.81 NR4A1 (0.45) LPAR1SLC2A1LTA4HTSHRHSD17B10

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1644321-B1 NEW BENZAMIDES AS PPATY MODULATORS S A L V A T LAB SA (ES) 2011-02-09 EP disclosed